(Q76009748)

(1R,3aS,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bS)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde

inferred from SMILES

stereoisomer of

2 references

(1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bS)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde

2 references

(1R,3aS,5aR,5bR,7aS,9S,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbaldehyde

2 references

3-Hydroxylup-20(29)-en-28-al

1 reference

chemical formula

C₃₀H₄₈O₂

0 references

canonical SMILES

O=CC12CCC(C(=C)C)C2C3CCC4C5(C)CCC(O)C(C)(C)C5CCC4(C)C3(C)CC1

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isomeric SMILES

CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C=O

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found in taxon

Cichorium intybus

1 reference

alpha-Glucosidase inhibitory activity of triterpenoids from Cichorium intybus

Melaleuca ericifolia

1 reference

Antiproliferative triterpenes from Melaleuca ericifolia.

Dillenia papuana

1 reference

Antibacterial triterpenoid acids from Dillenia papuana.

Doliocarpus dentatus

1 reference

Isolation of leishmanicidal triterpenes and lignans from the Amazonian liana Doliocarpus dentatus (dilleniaceae)

Bersama swinnyi

1 reference

Triterpenoids from Bersama swinnyi.

Diospyros canaliculata

1 reference

Naphthoquinones and triterpenes from african Diospyros species

Diospyros eriantha

2 references

Constituents of the Heartwood of Diospyros Eriantha

The constituents of the bark of diospyros maritima bl.

Lawsonia inermis

1 reference

Triterpenoids from Lawsonia alba.

Maerua oblongifolia

1 reference

A lupane triterpenoid from Maerua oblongifolia

Melaleuca leucadendra

3 references

A New Norlupene from the Leaves of Melaleuca leucadendron

Biologically Active constituents of Melaleuca leucadendron: Inhibitors of Induced Histamine Release from Rat Mast Cells

Biologically Active constituents of Melaleuca leucadendron: Inhibitors of Induced Histamine Release from Rat Mast Cells

Melilotus messanensis

1 reference

Potential allelopathic lupane triterpenes from bioactive fractions of melilotus messanensis*

Melilotus siculus

1 reference

Potential allelopathic lupane triterpenes from bioactive fractions of melilotus messanensis*

Paliurus hemsleyanus

1 reference

Triterpenes from Paliurus hemsleyanus

Phoradendron reichenbachianum

1 reference

Cytotoxic activity of moronic acid and identification of the new triterpene 3,4-seco-olean-18-ene-3,28-dioic acid from Phoradendron reichenbachianum

Sarracenia flava

1 reference

The isolation from Sarracenia flava and partial synthesis of betulinaldehyde

Ceriops decandra

1 reference

Lupane-Triterpene Esters from the Leaves of Ceriops decandra (Griff.) Ding Hou

Cornus kousa

1 reference

CYTOTOXIC TRITERPENOIDS FROM Cornus kousa FRUITS

Diospyros maritima

1 reference

Chemical constituents from the stems of Diospyros maritima

Diospyros virginiana

1 reference

Antifungal metabolites from the roots of Diospyros virginiana by overpressure layer chromatography.

Diospyros wallichii

1 reference

Naphthalene derivatives from Diospyros wallichii

Strobilanthes psilostachys

1 reference

Novel cadinane and norcadinane sesquiterpenes and a new propanoate from Goldfussia psilostachys

Monteverdia cuzcoina

2 references

Lupane triterpenoids from Maytenus species

Activity of lupane triterpenoids from Maytenus species as inhibitors of nitric oxide and prostaglandin E2.

Prunus dulcis

1 reference

Antiproliferative terpenoids from almond hulls (Prunus dulcis): identification and structure-activity relationships

Strobilanthes dimorphotricha

1 reference

Novel cadinane and norcadinane sesquiterpenes and a new propanoate from Goldfussia psilostachys

Strobilanthes pentstemonoides

1 reference

Novel cadinane and norcadinane sesquiterpenes and a new propanoate from Goldfussia psilostachys

Prunus avium

1 reference

Antiproliferative terpenoids from almond hulls (Prunus dulcis): identification and structure-activity relationships

Identifiers

InChI

InChI=1S/C30H48O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-25,32H,1,8-17H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1

0 references

InChIKey

FELCJAPFJOPHSD-ROUWMTJPSA-N

0 references

PubChem CID

99615

1 reference

matched by identifier from

InChIKey

FELCJAPFJOPHSD-ROUWMTJPSA-N

ChEBI ID

177424

mapping relation type

exact match

2 references

matched by identifier from

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C30H48O2/c1-19(2)20-10-15-30(18-31)17-16-28(6)21(25(20)30)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h18,20-25,32H,1,8-17H2,2-7H3/t20-,21+,22-,23+,24-,25+,27-,28+,29+,30+/m0/s1

SureChEMBL ID

SCHEMBL208983

2 references