(Q27134708)

Sarcophyton polyhydroxysterol (English)

7 October 2016

chemical formula

C₂₉H₅₀O₄

1 reference

Sarcophyton polyhydroxysterol (English)

7 October 2016

canonical SMILES

CC(C)C(C)C(C)CC(C)(C1=CCC2C1(CCC3C2CC(C4(C3(CCC(C4)O)C)O)O)C)O

1 reference

Sarcophyton polyhydroxysterol (English)

7 October 2016

isomeric SMILES

CC(C)C(C)C(C)C[C@@](C)(C1=CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@H]([C@@]4([C@@]3(CC[C@@H](C4)O)C)O)O)C)O

1 reference

Sarcophyton polyhydroxysterol (English)

InChI=1S/C29H50O4/c1-17(2)19(4)18(3)15-28(7,32)24-9-8-22-21-14-25(31)29(33)16-20(30)10-13-27(29,6)23(21)11-12-26(22,24)5/h9,17-23,25,30-33H,8,10-16H2,1-7H3/t18?,19?,20-,21-,22-,23-,25+,26-,27+,28-,29-/m0/s1

7 October 2016

Identifiers

InChI

1 reference

Sarcophyton polyhydroxysterol (English)

FSVRNTKWAJDYID-RVFKALSBSA-N

7 October 2016

InChIKey

2 references

Sarcophyton polyhydroxysterol (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(3beta,5alpha,6beta,24xi)-23-Methylergost-16-ene-3,5,6,20-tetrol (English)

7 October 2016

1 reference

Sarcophyton polyhydroxysterol (English)

7 October 2016

ChEBI ID

66175

mapping relation type

1 reference