ID: 30892
SMILES:C1(C)(C)C2(C)Oc3c(c(O)cc(CCCCC)c3)C3C2C(CC1)C3(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -13.196
InChIKey:VXTWCLHFODRXMB-UHFFFAOYSA-N
ID: 30893
SMILES:C1(C)C(=O)CCC(=C)C2C(CC1)C(C)(C)Oc1c2c(OC)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.467
InChIKey:GMLXCYWAWGLMLF-UHFFFAOYSA-N
ID: 30894
SMILES:C1(C)C2C(OC1)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.515
InChIKey:SLKQQLWNDGFPMR-UHFFFAOYSA-N
ID: 30895
SMILES:O=C1C2C(CC=C1C)C(C)(C)Oc1c2c(O)cc(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -17.439
InChIKey:NXWXGRHVAFTVMW-UHFFFAOYSA-N
ID: 30896
SMILES:C1(C)(C)C2C1c1ccc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.351
CB1 binding score: -14.549
InChIKey:KMVQBHFLGCCZAK-UHFFFAOYSA-N
ID: 30897
SMILES:C(CCC)Cc1cc(O)cc2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.296
InChIKey:SBDHCUZETSWOAX-UHFFFAOYSA-N
ID: 30898
SMILES:C1(C)(CCC=C(C)C)C2C3C(O)(c4c(ccc(CCCCC)c4)OC3(C)CC2)C(=O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.646
InChIKey:FYKNKADDQPNREF-UHFFFAOYSA-N
ID: 30899
SMILES:c1(O)c2c(c(C(=O)C(C)CC)c(O)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 30900
SMILES:c1(CCCC)cc2c(c(O)c1)C1CC(C)(O2)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -17.933
InChIKey:YXFGNPXVGYLXKP-UHFFFAOYSA-N
ID: 30901
SMILES:O1c2cc(CCCCC)ccc2C2C1C(C)CCC2C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.015
InChIKey:LBDYZDFIDNQRGH-UHFFFAOYSA-N
ID: 30902
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 30903
SMILES:c1c(O)ccc2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.912
InChIKey:JKUWZILTAIFPQY-UHFFFAOYSA-N
ID: 30904
SMILES:C(Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C(O)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.026
InChIKey:GWSPOZKXWMVVEN-UHFFFAOYSA-N
ID: 30905
SMILES:C1C23CC(C)(OC2)C(c2c(CCCCC)cc(O)c(CC=C(C)C)c2)C3C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.118
InChIKey:NWLITDICTHPVPT-UHFFFAOYSA-N
ID: 30906
SMILES:C(CC)CCc1c(C(O)=O)cc(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 344.495
CB1 binding score: -16.739
InChIKey:VBQFGFHTLZPXMK-UHFFFAOYSA-N
ID: 30907
SMILES:c1(O)c(C(C(=O)C)C)c(O)c(C(OC(C)=O)C(CC)C)c2c1C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.595
CB1 binding score: -14.009
InChIKey:RQJDBUUSFZSKBW-UHFFFAOYSA-N
ID: 30908
SMILES:c1(CCCCC)cc2c(c(O)c1OC)C=CC(C)(CC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: Not available
InChIKey:WWGBCNPNAZKXDH-UHFFFAOYSA-N
ID: 30909
SMILES:C1CC2(C)C(C=C1C(=C)CCC=C(C)C)Oc1c(c(OC)cc(CCCCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.68
CB1 binding score: -14.584
InChIKey:HLJRHGJKGLAYEE-UHFFFAOYSA-N
ID: 30910
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 30911
SMILES:C1C2(Oc3c1c(O)cc(CCCCC)c3)C1CC(C(C)=C)CC(=O)C1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.728
InChIKey:DLPLFFIINUEERX-UHFFFAOYSA-N
ID: 30912
SMILES:C(CC)CCc1cc(O)c(C2C(C(COC(CC(C)C)=O)=C)C(O)CC(C=O)=C2)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -16.736
InChIKey:WIUYBXCDAHRCAQ-UHFFFAOYSA-N