ID: 93010
SMILES:C(CCC)c1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -20.03
InChIKey:LXMICYYYVWWGAM-UHFFFAOYSA-N
ID: 93011
SMILES:C1(C)(C)C2C(c3c(cc(CCCCC)cc3OC)O1)C(=O)C1=CC(C=C)(C)CCC12O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -14.761
InChIKey:FKNNUPJRPCNYOY-UHFFFAOYSA-N
ID: 93012
SMILES:c1(C(OC)=O)c(O)c2c(cc1C)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -16.943
InChIKey:LANVZNPMUYHEOO-UHFFFAOYSA-N
ID: 93013
SMILES:C(Cc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)NCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 343.511
CB1 binding score: -14.918
InChIKey:QQYRDHLAHHKNAL-UHFFFAOYSA-N
ID: 93014
SMILES:c1c(O)c2c(cc1CCCCCC)OC(C)(C)C(O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -16.655
InChIKey:CUHWXRGGKNVNAB-UHFFFAOYSA-N
ID: 93015
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2C(CC(C)=CCC1)OC(C=CC)=C2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -12.424
InChIKey:WLFOIJONVPSTDM-UHFFFAOYSA-N
ID: 93016
SMILES:C1(c2c(O)cc(CCCCC)cc2)C=C(C=O)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -16.333
InChIKey:HRIAHIBPISIAEK-UHFFFAOYSA-N
ID: 93017
SMILES:C1(C)(C)Oc2c(cc(CCCCC)cc2O)C2C1CCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.255
InChIKey:WUDWBPLYPSLFSW-UHFFFAOYSA-N
ID: 93018
SMILES:C1C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 93019
SMILES:C123C(C)CCC1C(C)(C)Oc1cc(CCCCC)cc(O)c1C2CC(C)=C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.481
InChIKey:DOLLPZQMRJAYTN-UHFFFAOYSA-N
ID: 93020
SMILES:Oc1c(C=O)c(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.767
InChIKey:NVZOPKWQGYETGZ-UHFFFAOYSA-N
ID: 93021
SMILES:C(CCCC)c1ccc2c(c1O)C1=C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.334
InChIKey:HOVSBOROYMOKPK-UHFFFAOYSA-N
ID: 93022
SMILES:OCC12c3c(cc(CCCCC)cc3)OC(C)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -15.413
InChIKey:LEFDNISSPSJPTG-UHFFFAOYSA-N
ID: 93023
SMILES:Cc1cc2c(c(O)c1)-c1c(O)cc(CCCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -16.851
InChIKey:DQUQOWKYOZGEKK-UHFFFAOYSA-N
ID: 93024
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(C(CCC=C(C)C)C(=O)O1)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.75
InChIKey:GMUXFSFUOTYUPT-UHFFFAOYSA-N
ID: 93025
SMILES:C(CC)Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 93026
SMILES:CC(=CCCC(C)=CCc1c(O)cc(CCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 356.55
CB1 binding score: -18.934
InChIKey:LDZQKZLPWVBJOB-UHFFFAOYSA-N
ID: 93027
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 93028
SMILES:O=C(C)OC1CC=C(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C(C2C=O)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.65
CB1 binding score: -17.442
InChIKey:PJDNJNINDARAAE-UHFFFAOYSA-N
ID: 93029
SMILES:C1(C)CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -16.124
InChIKey:LRIDODXBBYTTIP-UHFFFAOYSA-N
ID: 93030
SMILES:c12c(O)c(C(=O)O)c(CCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.503
InChIKey:OIVPAQDCMDYIIL-UHFFFAOYSA-N