(Q115785607)

English

(3S,4aR,6aR,6bS,8aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,13,14,14a-tetradecahydropicen-3-ol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

oleanane triterpenoid

1 reference

based on heuristic

inferred from SMILES

mass

426.38616622 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

(3R,4aR,6aR,6bS,8aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,13,14,14a-tetradecahydropicen-3-ol

2 references

based on heuristic

inferred from InChIKey

2 references

inferred from InChIKey

1 reference

C₃₀H₅₀O

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canonical SMILES

OC1CCC2(C)C(CCC3(C)C2CCC4=C5CC(C)(C)CCC5(C)CCC43C)C1(C)C

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isomeric SMILES

CC1(C)CC[C@]2(C)CC[C@]3(C)C(=C2C1)CC[C@@H]1[C@]2(C)CC[C@H](O)C(C)(C)[C@@H]2CC[C@]13C

0 references

found in taxon

tomato

1 reference

stated in

Composition of the surface wax from tomatoes

Identifiers

InChI

InChI=1S/C30H50O/c1-25(2)15-16-27(5)17-18-29(7)20(21(27)19-25)9-10-23-28(6)13-12-24(31)26(3,4)22(28)11-14-30(23,29)8/h22-24,31H,9-19H2,1-8H3/t22-,23 ,24-,27 ,28 ,29 ,30 /m0/s1

0 references

InChIKey

JOCIRBSYAYKMEF-NJVNPNENSA-N

0 references

2 references

21 December 2022

inferred from InChIKey

matched by identifier from

InChIKey

JOCIRBSYAYKMEF-NJVNPNENSA-N

(Q115785607)

(3S,4aR,6aR,6bS,8aR,14aR,14bS)-4,4,6a,6b,8a,11,11,14b-octamethyl-1,2,3,4a,5,6,7,8,9,10,12,13,14,14a-tetradecahydropicen-3-ol

Statements

Identifiers

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