ID: 52627
SMILES:CC(=CCCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 52628
SMILES:C(c1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)C1C(C)(C)OCC(C)C1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.798
CB1 binding score: -13.421
InChIKey:XXLTUSTWRLRJRO-UHFFFAOYSA-N
ID: 52629
SMILES:O(c1c(CCCC)cc(O)c2c1C1C(C(C)(C)O2)CC=C(C)C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.467
InChIKey:HUCMFUVCDDYJOB-UHFFFAOYSA-N
ID: 52630
SMILES:C1C(C)C(CO)C2=CCC3C(C)(C)Oc4c(c(O)cc(CCC)c4)C3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.533
CB1 binding score: -15.681
InChIKey:ZMMUJQBRNAFRPT-UHFFFAOYSA-N
ID: 52631
SMILES:C1C2(C)Oc3c(c(O)cc(CCCCC)c3)C3OC(C)(C)C(CCC(C)=CC1)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.131
InChIKey:PCLUNVGRFJASIQ-UHFFFAOYSA-N
ID: 52632
SMILES:C(=C(C)C)CCC(C)=CCc1c(O)cc(CCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -20.03
InChIKey:LXMICYYYVWWGAM-UHFFFAOYSA-N
ID: 52633
SMILES:C1=CC(C)(C)Oc2cc(CCCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.086
InChIKey:JTNXKCXODVSTAX-UHFFFAOYSA-N
ID: 52634
SMILES:C(CCC=C(C)C)(=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: 52635
SMILES:Cc1cc(O)c(O)c2c1CC(C(=C)C)C(CCC=C(C)C)(C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.002
InChIKey:GJNYCDPMIXIJAH-UHFFFAOYSA-N
ID: 52636
SMILES:C1(C)(CCC=C(C)C)Oc2c(c(O)cc(CCCCC)c2)C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.376
InChIKey:AAZSXXIEAYXFSH-UHFFFAOYSA-N
ID: 52637
SMILES:c1(C=C(C)CCC=C(C)C)ccc(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.546
CB1 binding score: -15.107
InChIKey:JHDIZLFLNZJXGR-UHFFFAOYSA-N
ID: 52638
SMILES:c1(CCC)cc2c(c(O)c1)C1CC(C)(O2)CCC1C(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -17.624
InChIKey:RRQVSLLVCGRJNI-UHFFFAOYSA-N
ID: 52639
SMILES:O1c2c(cc(O)c(CC=C(CCC=C(C)C)C)c2)CC1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.43
InChIKey:SCABXBQQYONFIE-UHFFFAOYSA-N
ID: 52640
SMILES:O(C(C)=O)C(c1c2c3c(cc1O)OC(C)(C)C1CCC(C)(CC13)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.079
InChIKey:DECBKOLZGVIOSA-UHFFFAOYSA-N
ID: 52641
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 52642
SMILES:C1=C(C)CCC2C(C)(C)Oc3c(c(C)ccc3)C12O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -15.8
InChIKey:RCILFISDTLPOIJ-UHFFFAOYSA-N
ID: 52643
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC2C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.222
InChIKey:NDUVNHVQQDBWAD-UHFFFAOYSA-N
ID: 52644
SMILES:CC1=CC2C(C(C)C)(O)CC1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.792
InChIKey:OWLCBPWWMVWJHL-UHFFFAOYSA-N
ID: 52645
SMILES:Oc1c(C2C=C(C)CCC2C(=C)C)c(O)cc(OC)c1CC=C(C)CC=CC(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.172
InChIKey:SCRADVKBNKGVRH-UHFFFAOYSA-N
ID: 52646
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(CCC=C(C)C)(C)O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -19.284
InChIKey:GJHUUCABDYFFDB-UHFFFAOYSA-N
ID: 52647
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)COC(C)=O)C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -12.626
InChIKey:CAGDTEPIMLLFTP-UHFFFAOYSA-N