ID: 87046
SMILES:C(CCC(CO)=CCc1c(O)c(C(O)=O)c(CCCCC)cc1O)C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.239
InChIKey:RVEISLMFBYXNFF-UHFFFAOYSA-N
ID: 87047
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(C)C(O)(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.927
InChIKey:PADURIXMFVMQSY-UHFFFAOYSA-N
ID: 87048
SMILES:C(=C(CC(CC(C)C)=O)C)C#Cc1c(CCCCCC)cc2c(c1O)OC(C)(C)C1C2C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.71
CB1 binding score: -15.434
InChIKey:NAVXDHLMLUOAQF-UHFFFAOYSA-N
ID: 87049
SMILES:C(Cc1c(O)cc(CCCCC)cc1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 87050
SMILES:COc1c(O)c(C)cc2c1-c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.108
InChIKey:HSMAQNBDNZONOG-UHFFFAOYSA-N
ID: 87051
SMILES:C1CC2(C(C)(C)Oc3cc(C(C)C)cc(O)c32)C23C1(C)C(=O)CC2C(C)(C)O3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -16.033
InChIKey:FYIKWBXGACUNBE-UHFFFAOYSA-N
ID: 87052
SMILES:c12cc(CCCCC)cc(OC(=O)C)c1OC(C)(C)C1OC1CC(C)=CCCC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.624
CB1 binding score: -14.529
InChIKey:PCVNXHYGMCFDAI-UHFFFAOYSA-N
ID: 87053
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 87054
SMILES:CC1=CC2c3c(O)c(c(=O)c(C)cc3OCC3(C)C4CCC(C)C14)C23C(O)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -15.288
InChIKey:JERHPLJWEOCVQN-UHFFFAOYSA-N
ID: 87055
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)C(=O)C21O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.434
InChIKey:SUIYHRSVQMWRDX-UHFFFAOYSA-N
ID: 87056
SMILES:C1=C(C)C(O)CC(C(C)=C)C1c1c(O)c(C=O)c(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.507
InChIKey:CRGPVGJMVJKNCR-UHFFFAOYSA-N
ID: 87057
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(CCC=C(C)C)(C)O2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -14.712
InChIKey:JUUNKNXOFZPHTK-UHFFFAOYSA-N
ID: 87058
SMILES:CC1(O)C2CC=C(C)CC2c2c(O)cc(CCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.234
InChIKey:RPGUZEXFYWFBCX-UHFFFAOYSA-N
ID: 87059
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 87060
SMILES:O=C(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)CCC12)OO
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.042
InChIKey:KTFVFOVVUSFRQJ-UHFFFAOYSA-N
ID: 87061
SMILES:C1(C)CCC(C(C)C)C2=Cc3c(cc(CCCCC)cc3O)OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.084
InChIKey:SMYLCYBSJVJZNU-UHFFFAOYSA-N
ID: 87062
SMILES:c12c(OCCCCCCCl)cc(C)cc1OC1(C)CC3C(CCC(C)=C3)C(C)(CC2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 447.059
CB1 binding score: -15.965
InChIKey:STBTYRQSGJVDSW-UHFFFAOYSA-N
ID: 87063
SMILES:Oc1cc(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 87064
SMILES:C(C(O)=O)C1(C)Oc2c3c(cc(O)c2CCCCC1)OC(C)(C)C1C3C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.571
InChIKey:RPGFUKYTUBMUMY-UHFFFAOYSA-N
ID: 87065
SMILES:O=C(OC)c1c2c(c(O)c(CC=C(C)C)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -11.606
InChIKey:DHRYVNFGTDLPSQ-UHFFFAOYSA-N
ID: 87066
SMILES:O1c2c(c(C)c(C(=O)OC)c(O)c2CN(CCCCCc2ccccc2)C)CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.569
CB1 binding score: -19.258
InChIKey:WIDRZTHZBGAZFJ-UHFFFAOYSA-N