(Q104972573)

English

(2R,3R,4aS,8S,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene-2,3-diol

chemical compound

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instance of

type of chemical entity

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subclass of

4,4,8a-trimethyl-7-methylidene-8-(3-methylpenta-2,4-dienyl)-2,3,4a,5,6,8-hexahydro-1H-naphthalene-2,3-diol

1 reference

based on heuristic

inferred from SMILES

mass

304.240230264 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

Labda-8(20),12,14-triene-2alpha,3alpha-diol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R,3R,4aR,8S,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene-2,3-diol

1 reference

based on heuristic

inferred from InChI

ent-Labda-8(20),12Z,14-triene-2alpha,3beta-diol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₀H₃₂O₂

0 references

canonical SMILES

OC1CC2(C)C(C(=C)CCC2C(C)(C)C1O)CC=C(C=C)C

0 references

isomeric SMILES

C=C/C(C)=C/C[C@H]1C(=C)CC[C@@H]2C(C)(C)[C@@H](O)[C@H](O)C[C@]12C

0 references

found in taxon

Croton laevigatus

1 reference

stated in

Cytotoxic labdane diterpenoids from Croton oblongifolius

Chrozophora oblongifolia

1 reference

stated in

Cytotoxic labdane diterpenoids from Croton oblongifolius

Croton oblongifolius

1 reference

stated in

Cytotoxic labdane diterpenoids from Croton oblongifolius

Identifiers

InChI

InChI=1S/C20H32O2/c1-7-13(2)8-10-15-14(3)9-11-17-19(4,5)18(22)16(21)12-20(15,17)6/h7-8,15-18,21-22H,1,3,9-12H2,2,4-6H3/b13-8+/t15-,16+,17+,18-,20+/m0/s1

0 references

InChIKey

CYVDNLSWCPUNBX-OMTYTQKESA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

CYVDNLSWCPUNBX-OMTYTQKESA-N

(Q104972573)

(2R,3R,4aS,8S,8aR)-4,4,8a-trimethyl-7-methylidene-8-[(2E)-3-methylpenta-2,4-dienyl]-2,3,4a,5,6,8-hexahydro-1H-naphthalene-2,3-diol

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