ID: 9367
SMILES:CCCCCc1c(C(=O)O)c(O)cc2c1CC(O)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -14.737
InChIKey:WQVJGAJKESBBJF-UHFFFAOYSA-N
ID: 9368
SMILES:Oc1cc(C)cc2c1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.696
InChIKey:WNKDAZLOXAUXJL-UHFFFAOYSA-N
ID: 9369
SMILES:C12C(C)CCC3C(C)(C)Oc4c(c(O)cc(C)c4)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.073
InChIKey:NIJYACMLQHAJJA-UHFFFAOYSA-N
ID: 9370
SMILES:COc1cc(C)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 268.356
CB1 binding score: -17.579
InChIKey:UEXVDOATPCCQRD-UHFFFAOYSA-N
ID: 9371
SMILES:C1C(C)=CC(c2cc(CCN(C)C)ccc2OC)C(C(C)=C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 9372
SMILES:c1c(CCc2ccc(OC)cc2)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -12.861
InChIKey:KIEJVDZEXZBXFA-UHFFFAOYSA-N
ID: 9373
SMILES:CC(C1C=CC(C)=CC1c1c(O)cc(CCCCC[N+](C)(C)C)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.573
CB1 binding score: -16.169
InChIKey:JHHKIINOAVCGHA-UHFFFAOYSA-O
ID: 9374
SMILES:Oc1cc(CCC)cc2c1C1C=C(C(=O)OC)C(OC)CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.039
InChIKey:WULOGWQWFJHWOZ-UHFFFAOYSA-N
ID: 9375
SMILES:C(=C)(C)C(=C)Cc1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -14.202
InChIKey:QVAASEGOAOHBPH-UHFFFAOYSA-N
ID: 9376
SMILES:O=c1cc2c(ccc1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -16.41
InChIKey:WKHDHOMHSWKHJO-UHFFFAOYSA-N
ID: 9377
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C2CC1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.605
InChIKey:MGTMEERZHJBBNJ-UHFFFAOYSA-N
ID: 9378
SMILES:O(c1c(C)nc2c(c1C)OC(C)(C)C1CCC(C)=CC21)CCN(CCCl)CCI
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.894
CB1 binding score: -17.334
InChIKey:DYOZEBUEYYKACA-UHFFFAOYSA-N
ID: 9379
SMILES:OC12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC2(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -18.775
InChIKey:RAJZYPNAKPJLJI-UHFFFAOYSA-N
ID: 9380
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(OC)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 9381
SMILES:C(=O)(CC1=C(O)C2C(C)C(O)CC2C(C)(C)O1)C(=CC)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 294.391
CB1 binding score: -16.362
InChIKey:RPCKOFHRNXQNRL-UHFFFAOYSA-N
ID: 9382
SMILES:CC(C=C(C)C=CC(=O)c1c(O)c(C2C=C(C)CCC2C(C)=C)cc(O)c1OC)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.581
CB1 binding score: -15.321
InChIKey:HGODUZBWYRNQIF-UHFFFAOYSA-N
ID: 9383
SMILES:C1=C(C)C(OC(=O)C)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.943
InChIKey:UONIRULUKZFDJP-UHFFFAOYSA-N
ID: 9384
SMILES:c1(CCCCCC)cc(CC=C(C)CCc2c(O)cc(C)cc2O)c(O)c2c1CC(C(C)(C)O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -15.62
InChIKey:RUMFIFYPXHCNGB-UHFFFAOYSA-N
ID: 9385
SMILES:C12C(C(C)(C)Oc3c1c(O)cc(CCC)c3)C1OC1(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.401
InChIKey:TWUGUSSWCYIYFE-UHFFFAOYSA-N
ID: 9386
SMILES:C12=C(Oc3c(c(O)cc(CCCCC)c3)C(C(CCC=C(C)C)=C)=C1)C(C)(C)C(=O)C(C)=C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.63
CB1 binding score: -13.589
InChIKey:ZBWZAMLVLXSPAX-UHFFFAOYSA-N
ID: 9387
SMILES:O(C(C(C)(C)O)c1cc2c(c(OC)c1)C1C(C(C)C)(O2)CC=C(C)C1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -15.532
InChIKey:HJBXUMXGAXSTPT-UHFFFAOYSA-N