ID: 36646
SMILES:C1C=C(C)C2(C(C)(C)C1)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.263
InChIKey:SOFVNKJRFHIBDF-UHFFFAOYSA-N
ID: 36647
SMILES:Oc1cc(CCC)cc2c1C1C(O2)C(C)(O)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.123
InChIKey:SMXSKQNEQWKRKO-UHFFFAOYSA-N
ID: 36648
SMILES:CC1=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 36649
SMILES:C1(Cc2c(OC(C)=O)cc(CCCCC)cc2O)C(C)(C)C(O)C=CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -13.661
InChIKey:LKBJFZFPZYUTIL-UHFFFAOYSA-N
ID: 36650
SMILES:OC(=O)C(C)=CCCC1(C)Oc2c(c(O)cc(CCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -17.334
InChIKey:PQUYRLNMWYWUPG-UHFFFAOYSA-N
ID: 36651
SMILES:C1CC(C)=CCC2C(C)(C)Oc3cc(CCCCC)c(Br)c(c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 391.393
CB1 binding score: -15.855
InChIKey:JPIIPBVTNWJXDY-UHFFFAOYSA-N
ID: 36652
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CC1C(C)(CC2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.55
InChIKey:DQRFERPVWVTXJD-UHFFFAOYSA-N
ID: 36653
SMILES:c1c(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -19.225
InChIKey:BEXSRXTVRHPHGL-UHFFFAOYSA-N
ID: 36654
SMILES:O=C(C12CCC(C(C)=C)C1c1cc(CCCCC)ccc1C=C2O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.84
InChIKey:USJLZNOWBNQYDT-UHFFFAOYSA-N
ID: 36655
SMILES:CC1(C)Oc2cc(CCCCC)c(C(=O)O)c(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.348
CB1 binding score: -18.13
InChIKey:BQOIKHJQWFSXOS-UHFFFAOYSA-N
ID: 36656
SMILES:C1=C2C3(OC(C)(C)C1CC3)c1c(cc(C)c(Br)c1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 379.294
CB1 binding score: -15.158
InChIKey:NBZPUAXFBIZULA-UHFFFAOYSA-N
ID: 36657
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 36658
SMILES:C(C)(C)(C1C(c2c(O)cc(CCC)cc2O)CC(C)=CC1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.987
InChIKey:CYWNGHQPFIJSAD-UHFFFAOYSA-N
ID: 36659
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1(C(=O)O2)C2(C)C(C(C)(C)CCC2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -13.053
InChIKey:QUQKJAWJXKYBSP-UHFFFAOYSA-N
ID: 36660
SMILES:OC1C(O)C(O)C(OC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2=CC=C(C)C)OC1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.609
CB1 binding score: -10.608
InChIKey:ZFVYZWCKLGADNS-UHFFFAOYSA-N
ID: 36661
SMILES:C(OC(C)=O)(C1CCC(C)=CC1c1c(OC)cc(CCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.775
InChIKey:QHWKISPEWQDGLK-UHFFFAOYSA-N
ID: 36662
SMILES:C1(C)=CC2c3c(CCCCC)cc(O)cc3C(CC1C(O)(C)C)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.642
InChIKey:AKKQYRKAUJBZQH-UHFFFAOYSA-N
ID: 36663
SMILES:c1(OC)c2c(c(C(=O)CC(C)C)cc1C)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -11.553
InChIKey:GAYRRNJOMYYGOB-UHFFFAOYSA-N
ID: 36664
SMILES:C1C(C)CCCC(C)CCCC(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.609
CB1 binding score: -16.022
InChIKey:FXBDZBWBAJXUDT-UHFFFAOYSA-N
ID: 36665
SMILES:C12C(C)(C)Oc3c(c(O)ccc3)C1CC1(O)C(C)(C(C)C(O)CC1=O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.949
InChIKey:HLVNTHLURCWDDH-UHFFFAOYSA-N
ID: 36666
SMILES:c1c2c(cc(CCCCC)c1)OC(CCC=C(C)C)(C)C(OC)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.753
InChIKey:CYWQMFHSMSXCNH-UHFFFAOYSA-N