(Q105188873)

English

1-Methyl-1-[(7S,8S,1E,3E,11E)-4,8,12-trimethyl-7,8-epoxycyclotetradeca-1,3,11-triene-1-yl]ethanol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

2-(4,10,14-Trimethyl-15-oxabicyclo[12.1.0]pentadeca-4,6,10-trien-7-yl)propan-2-ol

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

2-[(1R,4E,6E,10E,14R)-4,10,14-trimethyl-15-oxabicyclo[12.1.0]pentadeca-4,6,10-trien-7-yl]propan-2-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₂

0 references

canonical SMILES

OC(C1=CC=C(C)CCC2OC2(C)CCC=C(C)CC1)(C)C

0 references

isomeric SMILES

C/C1=C\CC[C@]2(C)O[C@H]2CC/C(C)=C/C=C(/C(C)(C)O)CC1

0 references

found in taxon

Sarcophyton trocheliophorum

1 reference

stated in

A new cytotoxic polyhydroxysterol from soft coral Sarcophyton trocheliophorum

Identifiers

InChI

InChI=1S/C20H32O2/c1-15-7-6-14-20(5)18(22-20)13-10-16(2)9-12-17(11-8-15)19(3,4)21/h7,9,12,18,21H,6,8,10-11,13-14H2,1-5H3/b15-7+,16-9+,17-12+/t18-,20-/m0/s1

0 references

InChIKey

OAWYUCSBLMUTFD-UTRNGOQDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

OAWYUCSBLMUTFD-UTRNGOQDSA-N

ChEBI ID

182113

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C20H32O2/c1-15-7-6-14-20(5)18(22-20)13-10-16(2)9-12-17(11-8-15)19(3,4)21/h7,9,12,18,21H,6,8,10-11,13-14H2,1-5H3/b15-7+,16-9+,17-12+/t18-,20-/m0/s1

(Q105188873)

1-Methyl-1-[(7S,8S,1E,3E,11E)-4,8,12-trimethyl-7,8-epoxycyclotetradeca-1,3,11-triene-1-yl]ethanol

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Identifiers

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