2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid

C268H500N38O152S38 — CID 58174824

IUPAC2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid
SMILESCCC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(C)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O
InChIInChI=1S/C268H500N38O152S38/c1-79-156(194(308)270-232(5,6)118-460(348,349)350)81-158(196(310)272-234(9,10)120-462(354,355)356)83-160(198(312)274-236(13,14)122-464(360,361)362)85-162(200(314)276-238(17,18)124-466(366,367)368)87-164(202(316)278-240(21,22)126-468(372,373)374)89-166(204(318)280-242(25,26)128-470(378,379)380)91-168(206(320)282-244(29,30)130-472(384,385)386)93-170(208(322)284-246(33,34)132-474(390,391)392)95-172(210(324)286-248(37,38)134-476(396,397)398)97-174(212(326)288-250(41,42)136-478(402,403)404)99-176(214(328)290-252(45,46)138-480(408,409)410)101-178(216(330)292-254(49,50)140-482(414,415)416)103-180(218(332)294-256(53,54)142-484(420,421)422)105-182(220(334)296-258(57,58)144-486(426,427)428)107-184(222(336)298-260(61,62)146-488(432,433)434)109-186(224(338)300-262(65,66)148-490(438,439)440)111-188(226(340)302-264(69,70)150-492(444,445)446)113-190(228(342)304-266(73,74)152-494(450,451)452)115-192(230(344)306-268(77,78)154-496(456,457)458)116-191(229(343)305-267(75,76)153-495(453,454)455)114-189(227(341)303-265(71,72)151-493(447,448)449)112-187(225(339)301-263(67,68)149-491(441,442)443)110-185(223(337)299-261(63,64)147-489(435,436)437)108-183(221(335)297-259(59,60)145-487(429,430)431)106-181(219(333)295-257(55,56)143-485(423,424)425)104-179(217(331)293-255(51,52)141-483(417,418)419)102-177(215(329)291-253(47,48)139-481(411,412)413)100-175(213(327)289-251(43,44)137-479(405,406)407)98-173(211(325)287-249(39,40)135-477(399,400)401)96-171(209(323)285-247(35,36)133-475(393,394)395)94-169(207(321)283-245(31,32)131-473(387,388)389)92-167(205(319)281-243(27,28)129-471(381,382)383)90-165(203(317)279-241(23,24)127-469(375,376)377)88-163(201(315)277-239(19,20)125-467(369,370)371)86-161(199(313)275-237(15,16)123-465(363,364)365)84-159(197(311)273-235(11,12)121-463(357,358)359)82-157(195(309)271-233(7,8)119-461(351,352)353)80-155(2)193(307)269-231(3,4)117-459(345,346)347/h155-192H,79-154H2,1-78H3,(H,269,307)(H,270,308)(H,271,309)(H,272,310)(H,273,311)(H,274,312)(H,275,313)(H,276,314)(H,277,315)(H,278,316)(H,279,317)(H,280,318)(H,281,319)(H,282,320)(H,283,321)(H,284,322)(H,285,323)(H,286,324)(H,287,325)(H,288,326)(H,289,327)(H,290,328)(H,291,329)(H,292,330)(H,293,331)(H,294,332)(H,295,333)(H,296,334)(H,297,335)(H,298,336)(H,299,337)(H,300,338)(H,301,339)(H,302,340)(H,303,341)(H,304,342)(H,305,343)(H,306,344)(H,345,346,347)(H,348,349,350)(H,351,352,353)(H,354,355,356)(H,357,358,359)(H,360,361,362)(H,363,364,365)(H,366,367,368)(H,369,370,371)(H,372,373,374)(H,375,376,377)(H,378,379,380)(H,381,382,383)(H,384,385,386)(H,387,388,389)(H,390,391,392)(H,393,394,395)(H,396,397,398)(H,399,400,401)(H,402,403,404)(H,405,406,407)(H,408,409,410)(H,411,412,413)(H,414,415,416)(H,417,418,419)(H,420,421,422)(H,423,424,425)(H,426,427,428)(H,429,430,431)(H,432,433,434)(H,435,436,437)(H,438,439,440)(H,441,442,443)(H,444,445,446)(H,447,448,449)(H,450,451,452)(H,453,454,455)(H,456,457,458)
InChIKeySKMXYYZRKXZVIK-UHFFFAOYSA-N
MW7905.61 g/mol
LogP-7.00
Rot. Bonds227

About 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid

2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid (PubChem CID 58174824) has the molecular formula C268H500N38O152S38 and a molecular weight of 7905.61 g/mol. Its IUPAC name is 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid.

Molecular Properties

Compound Name2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid
PubChem CID58174824
Molecular FormulaC268H500N38O152S38
Molecular Weight7905.61 g/mol
Exact Mass7898.20
IUPAC Name2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid
SMILESCCC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(C)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O
InChIInChI=1S/C268H500N38O152S38/c1-79-156(194(308)270-232(5,6)118-460(348,349)350)81-158(196(310)272-234(9,10)120-462(354,355)356)83-160(198(312)274-236(13,14)122-464(360,361)362)85-162(200(314)276-238(17,18)124-466(366,367)368)87-164(202(316)278-240(21,22)126-468(372,373)374)89-166(204(318)280-242(25,26)128-470(378,379)380)91-168(206(320)282-244(29,30)130-472(384,385)386)93-170(208(322)284-246(33,34)132-474(390,391)392)95-172(210(324)286-248(37,38)134-476(396,397)398)97-174(212(326)288-250(41,42)136-478(402,403)404)99-176(214(328)290-252(45,46)138-480(408,409)410)101-178(216(330)292-254(49,50)140-482(414,415)416)103-180(218(332)294-256(53,54)142-484(420,421)422)105-182(220(334)296-258(57,58)144-486(426,427)428)107-184(222(336)298-260(61,62)146-488(432,433)434)109-186(224(338)300-262(65,66)148-490(438,439)440)111-188(226(340)302-264(69,70)150-492(444,445)446)113-190(228(342)304-266(73,74)152-494(450,451)452)115-192(230(344)306-268(77,78)154-496(456,457)458)116-191(229(343)305-267(75,76)153-495(453,454)455)114-189(227(341)303-265(71,72)151-493(447,448)449)112-187(225(339)301-263(67,68)149-491(441,442)443)110-185(223(337)299-261(63,64)147-489(435,436)437)108-183(221(335)297-259(59,60)145-487(429,430)431)106-181(219(333)295-257(55,56)143-485(423,424)425)104-179(217(331)293-255(51,52)141-483(417,418)419)102-177(215(329)291-253(47,48)139-481(411,412)413)100-175(213(327)289-251(43,44)137-479(405,406)407)98-173(211(325)287-249(39,40)135-477(399,400)401)96-171(209(323)285-247(35,36)133-475(393,394)395)94-169(207(321)283-245(31,32)131-473(387,388)389)92-167(205(319)281-243(27,28)129-471(381,382)383)90-165(203(317)279-241(23,24)127-469(375,376)377)88-163(201(315)277-239(19,20)125-467(369,370)371)86-161(199(313)275-237(15,16)123-465(363,364)365)84-159(197(311)273-235(11,12)121-463(357,358)359)82-157(195(309)271-233(7,8)119-461(351,352)353)80-155(2)193(307)269-231(3,4)117-459(345,346)347/h155-192H,79-154H2,1-78H3,(H,269,307)(H,270,308)(H,271,309)(H,272,310)(H,273,311)(H,274,312)(H,275,313)(H,276,314)(H,277,315)(H,278,316)(H,279,317)(H,280,318)(H,281,319)(H,282,320)(H,283,321)(H,284,322)(H,285,323)(H,286,324)(H,287,325)(H,288,326)(H,289,327)(H,290,328)(H,291,329)(H,292,330)(H,293,331)(H,294,332)(H,295,333)(H,296,334)(H,297,335)(H,298,336)(H,299,337)(H,300,338)(H,301,339)(H,302,340)(H,303,341)(H,304,342)(H,305,343)(H,306,344)(H,345,346,347)(H,348,349,350)(H,351,352,353)(H,354,355,356)(H,357,358,359)(H,360,361,362)(H,363,364,365)(H,366,367,368)(H,369,370,371)(H,372,373,374)(H,375,376,377)(H,378,379,380)(H,381,382,383)(H,384,385,386)(H,387,388,389)(H,390,391,392)(H,393,394,395)(H,396,397,398)(H,399,400,401)(H,402,403,404)(H,405,406,407)(H,408,409,410)(H,411,412,413)(H,414,415,416)(H,417,418,419)(H,420,421,422)(H,423,424,425)(H,426,427,428)(H,429,430,431)(H,432,433,434)(H,435,436,437)(H,438,439,440)(H,441,442,443)(H,444,445,446)(H,447,448,449)(H,450,451,452)(H,453,454,455)(H,456,457,458)
InChIKeySKMXYYZRKXZVIK-UHFFFAOYSA-N
XLogP-7.00
TPSA3171.86 Ų
H-Bond Donors76
H-Bond Acceptors114
Rotatable Bonds227
Heavy Atoms496
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5007905.61
LogP ≤ 5-7.00
H-Bond Donors ≤ 576
H-Bond Acceptors ≤ 10114

Analyze 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid?
The IUPAC name of 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid (CID 58174824) is 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid.
What is the SMILES notation for 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid?
The canonical SMILES for 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid is CCC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(CC(C)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O)C(=O)NC(C)(C)CS(=O)(=O)O.
What is the InChIKey of 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid?
The InChIKey is SKMXYYZRKXZVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C268H500N38O152S38/c1-79-156(194(308)270-232(5,6)118-460(348,349)350)81-158(196(310)272-234(9,10)120-462(354,355)356)83-160(198(312)274-236(13,14)122-464(360,361)362)85-162(200(314)276-238(17,18)124-466(366,367)368)87-164(202(316)278-240(21,22)126-468(372,373)374)89-166(204(318)280-242(25,26)128-470(378,379)380)91-168(206(320)282-244(29,30)130-472(384,385)386)93-170(208(322)284-246(33,34)132-474(390,391)392)95-172(210(324)286-248(37,38)134-476(396,397)398)97-174(212(326)288-250(41,42)136-478(402,403)404)99-176(214(328)290-252(45,46)138-480(408,409)410)101-178(216(330)292-254(49,50)140-482(414,415)416)103-180(218(332)294-256(53,54)142-484(420,421)422)105-182(220(334)296-258(57,58)144-486(426,427)428)107-184(222(336)298-260(61,62)146-488(432,433)434)109-186(224(338)300-262(65,66)148-490(438,439)440)111-188(226(340)302-264(69,70)150-492(444,445)446)113-190(228(342)304-266(73,74)152-494(450,451)452)115-192(230(344)306-268(77,78)154-496(456,457)458)116-191(229(343)305-267(75,76)153-495(453,454)455)114-189(227(341)303-265(71,72)151-493(447,448)449)112-187(225(339)301-263(67,68)149-491(441,442)443)110-185(223(337)299-261(63,64)147-489(435,436)437)108-183(221(335)297-259(59,60)145-487(429,430)431)106-181(219(333)295-257(55,56)143-485(423,424)425)104-179(217(331)293-255(51,52)141-483(417,418)419)102-177(215(329)291-253(47,48)139-481(411,412)413)100-175(213(327)289-251(43,44)137-479(405,406)407)98-173(211(325)287-249(39,40)135-477(399,400)401)96-171(209(323)285-247(35,36)133-475(393,394)395)94-169(207(321)283-245(31,32)131-473(387,388)389)92-167(205(319)281-243(27,28)129-471(381,382)383)90-165(203(317)279-241(23,24)127-469(375,376)377)88-163(201(315)277-239(19,20)125-467(369,370)371)86-161(199(313)275-237(15,16)123-465(363,364)365)84-159(197(311)273-235(11,12)121-463(357,358)359)82-157(195(309)271-233(7,8)119-461(351,352)353)80-155(2)193(307)269-231(3,4)117-459(345,346)347/h155-192H,79-154H2,1-78H3,(H,269,307)(H,270,308)(H,271,309)(H,272,310)(H,273,311)(H,274,312)(H,275,313)(H,276,314)(H,277,315)(H,278,316)(H,279,317)(H,280,318)(H,281,319)(H,282,320)(H,283,321)(H,284,322)(H,285,323)(H,286,324)(H,287,325)(H,288,326)(H,289,327)(H,290,328)(H,291,329)(H,292,330)(H,293,331)(H,294,332)(H,295,333)(H,296,334)(H,297,335)(H,298,336)(H,299,337)(H,300,338)(H,301,339)(H,302,340)(H,303,341)(H,304,342)(H,305,343)(H,306,344)(H,345,346,347)(H,348,349,350)(H,351,352,353)(H,354,355,356)(H,357,358,359)(H,360,361,362)(H,363,364,365)(H,366,367,368)(H,369,370,371)(H,372,373,374)(H,375,376,377)(H,378,379,380)(H,381,382,383)(H,384,385,386)(H,387,388,389)(H,390,391,392)(H,393,394,395)(H,396,397,398)(H,399,400,401)(H,402,403,404)(H,405,406,407)(H,408,409,410)(H,411,412,413)(H,414,415,416)(H,417,418,419)(H,420,421,422)(H,423,424,425)(H,426,427,428)(H,429,430,431)(H,432,433,434)(H,435,436,437)(H,438,439,440)(H,441,442,443)(H,444,445,446)(H,447,448,449)(H,450,451,452)(H,453,454,455)(H,456,457,458).
What are the key properties of 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid?
2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid has a molecular weight of 7905.61 g/mol, XLogP of -7.00, 227 rotatable bonds, 76 hydrogen bond donors, and 114 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-[[2-methyl-4,6,8,10,12,14,16,18,20,22,24,26,28,30,32,34,36,38,40,42,44,46,48,50,52,54,56,58,60,62,64,66,68,70,72,74,76-heptatriacontakis[(2-methyl-1-sulfopropan-2-yl)carbamoyl]octaheptacontanoyl]amino]propane-1-sulfonic acid is sourced from PubChem (CID 58174824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).