ID: 71023
SMILES:CC1(C)C2CCC(CO)=CC2c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.668
InChIKey:ULAFKXIIRFYROC-UHFFFAOYSA-N
ID: 71024
SMILES:Oc1c(C(=O)C(C)C)c2c(c(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.613
InChIKey:RAJTUPPMPIGCQD-UHFFFAOYSA-N
ID: 71025
SMILES:C1C(c2c(O)cc(CCCCC)cc2O)C(C)(c2ccc(O)cc2)C(=O)C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -15.721
InChIKey:AYHIAENVIAVNCR-UHFFFAOYSA-N
ID: 71026
SMILES:CC(OC1C(C(C)=C)Oc2cc(CCCCC)cc(O)c2C1CC(=O)C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.382
InChIKey:JTLPCFQKMUDMSD-UHFFFAOYSA-N
ID: 71027
SMILES:CC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 71028
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)C(O)CC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.502
InChIKey:BIQUDLWNBCLNIJ-UHFFFAOYSA-N
ID: 71029
SMILES:O=C(CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)cc1)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.671
InChIKey:VNNNSKKZMJZEON-UHFFFAOYSA-N
ID: 71030
SMILES:C(C1CCC(C)C2CC(C(C)C)C(c3c(O)cc(CCCCC)cc3O)C12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -14.433
InChIKey:GLAPTRPUNGDURM-UHFFFAOYSA-N
ID: 71031
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.894
InChIKey:RQOQOWJGKVZNGE-UHFFFAOYSA-N
ID: 71032
SMILES:Oc1c2c(cc(C)c1C=O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -17.835
InChIKey:PMBXVVOCCXZQKB-UHFFFAOYSA-N
ID: 71033
SMILES:C1CC(Cc2c(O)cc(CCCCC)cc2)C(C)(C)Oc2c1c(C)ccc2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.008
InChIKey:XNMLJKLRRXSUPM-UHFFFAOYSA-N
ID: 71034
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)c1c-2cc(C)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -18.202
InChIKey:MEXBLNORPUBQPI-UHFFFAOYSA-N
ID: 71035
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 71036
SMILES:C=C1Oc2c(cc(CCCCC)cc2O)C(O)C2C(C)(O2)CCC2C(C)(C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -15.929
InChIKey:IHMDIGGBUVDTGJ-UHFFFAOYSA-N
ID: 71037
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1C2C=C(CO)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 71038
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1(O2)C=CC(C)CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.632
InChIKey:DAYNBYUCAWJPRZ-UHFFFAOYSA-N
ID: 71039
SMILES:C12(C)c3c(O)cc(CCCCC)cc3OC3(C(C)CO3)CC1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -15.428
InChIKey:CERMCJBNAZWSDZ-UHFFFAOYSA-N
ID: 71040
SMILES:c1c(CCCCC)c(C(=O)O)cc2c1C1C(C(C)(C)O2)CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -7.37
InChIKey:UBXBHRBIJLEINX-UHFFFAOYSA-N
ID: 71041
SMILES:CC(C)CC(OC(C)C1=CC2c3c(c4c(c(O)c3)C=CC(C(C)C)=C4)OC(C)(C)C2CC1c1ccccc1)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 526.717
CB1 binding score: Not available
InChIKey:JDVCIIVHUORILW-UHFFFAOYSA-N
ID: 71042
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C=C(C)CCC1C(=C)CO2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.058
InChIKey:OKUTVPYGKPJQPQ-UHFFFAOYSA-N
ID: 71043
SMILES:C1(C)C(=O)C2c3c(O)cc(CCC)cc3OC1C2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -14.04
InChIKey:XUYPJSYCSDYONJ-UHFFFAOYSA-N