ID: 120016
SMILES:C(CCC=C(C)C)(C)=CCc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 120017
SMILES:C12c3c(c(O)cc(CCCCC)c3O)C3C(C=C(C)C)(CC(C)(C)CC13)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.601
InChIKey:AHYUXRAUZYHQNL-UHFFFAOYSA-N
ID: 120018
SMILES:CC1(C)C2(O)CCC1(C)Cc1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.547
InChIKey:SUIBYVHGCSOZSJ-UHFFFAOYSA-N
ID: 120019
SMILES:CC1(C)C2(O)CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.56
InChIKey:VBPOXSBFZQHISD-UHFFFAOYSA-N
ID: 120020
SMILES:C1=C(C)CC(c2c(O)cc(CCC)cc2OC)C(C(C)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -11.506
InChIKey:SUGDVOQLVBCBGV-UHFFFAOYSA-N
ID: 120021
SMILES:CC(C1C(c2c(O)cc(CCC)cc2OC)CC(C)=CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.771
InChIKey:SBJBCNWFLJHFTD-UHFFFAOYSA-N
ID: 120022
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC2C(C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.943
InChIKey:LKFLWBZTDVUDPA-UHFFFAOYSA-N
ID: 120023
SMILES:CC1(C)C2C(CC(C)=CC2)c2c(O)c(C(=O)O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.507
InChIKey:YKKHSYLGQXKVMO-UHFFFAOYSA-N
ID: 120024
SMILES:C(c1cc(O)c(C)c(O)c1CCCCC)(C(=O)OC)=CCC1C(C)(O)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.601
CB1 binding score: -12.65
InChIKey:IFMJSZQDARKLJV-UHFFFAOYSA-N
ID: 120025
SMILES:C(C)(C)=CCCC(=CCc1c(O)cc(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 120026
SMILES:c12c(c(CCCCC)c(C)cc1)CC(C(=C)C)C(CC(=O)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.011
InChIKey:VNPHTRCTIKAGPR-UHFFFAOYSA-N
ID: 120027
SMILES:C(C)(CCCC(C)(C1C2=C(Cc3cc(O)c(C)cc3O1)CCO2)C)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.895
InChIKey:APQLVUUPYOPPJF-UHFFFAOYSA-N
ID: 120028
SMILES:C1(C)=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 120029
SMILES:C(CCCc1cc2c(c(O)c1)C1CC(C)=CCC1C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 120030
SMILES:C(=C(CCC=C(C)C)C)C1CC=C(C)CC1c1c(O)cc(O)cc1CCCCCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.696
CB1 binding score: -16.94
InChIKey:JLMIZTHUHAWJGT-UHFFFAOYSA-N
ID: 120031
SMILES:C1C(CC(C)C)c2c(O)c(OC)c(C(O)C)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.418
CB1 binding score: -14.91
InChIKey:ZYHUEZQLFIPKGS-UHFFFAOYSA-N
ID: 120032
SMILES:CCCOC(=O)c1c(O)c(O)c2c(c1)Oc1c(c(O)cc(CCCCC)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 524.654
CB1 binding score: -13.351
InChIKey:VUTQCKRKTOZXHQ-UHFFFAOYSA-N
ID: 120033
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2I)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.246
CB1 binding score: -12.671
InChIKey:AXKOBHQBCWVKMM-UHFFFAOYSA-N
ID: 120034
SMILES:CC1=CC(c2c(O)cc(CCC)cc2OC)C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.172
InChIKey:ZLMHDSKDPRIBDQ-UHFFFAOYSA-N
ID: 120035
SMILES:C1(OC)OC2C3C(CC(C)C3=C)c3c(cc(CCCCC)cc3O)OC2(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.362
InChIKey:UOHNFSBUFJGBRF-UHFFFAOYSA-N
ID: 120036
SMILES:CCCc1cc(O)c2c3c1OC(C)(C)C1CCC(C)(O)C(CCC1=O)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.906
InChIKey:PSRDLDCHRPPYCH-UHFFFAOYSA-N