ID: 46726
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46727
SMILES:CC12Oc3c(c(OC(=O)C(=CC)C)cc(CCCCC)c3)C3C4(C)CCC1CC(C)(C)CC243
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -13.988
InChIKey:MUHZRQXRDCGNAP-UHFFFAOYSA-N
ID: 46728
SMILES:C1C(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46729
SMILES:C(Cc1cocc1)C(=O)C(Cc1cc2c(c(OC)c1)OCO2)C(C)c1cc2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 586.725
CB1 binding score: -14.506
InChIKey:HZILZOBXUIPVCA-UHFFFAOYSA-N
ID: 46730
SMILES:C(=O)(C)c1c2c3c(cc(O)c2cc(CCCCC)c1)OC(C)(C)C(O)C3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -15.846
InChIKey:VPAMQEXDTJGTQB-UHFFFAOYSA-N
ID: 46731
SMILES:O=S(O)(=O)Oc1cc(C(CC=C(C)CCCC(C)C)O)c(O)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 508.677
CB1 binding score: -15.547
InChIKey:NACIBFDSATXILW-UHFFFAOYSA-N
ID: 46732
SMILES:C(CCc1cc(OC(C)=O)c2c(c1)OC(C)(C)C1CCC(C)=CC21)CCCCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -11.656
InChIKey:LEHPSEYTFWSFBH-UHFFFAOYSA-N
ID: 46733
SMILES:C(C(C)C(=O)OC(C(c1cc(CC2=C(O)C(C)CC2)c(O)c(CC=C(C)CCC=C(C)C)c1O)=O)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.659
CB1 binding score: -14.68
InChIKey:VLZOUEUIANOKTL-UHFFFAOYSA-N
ID: 46734
SMILES:O=C(OC)C1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.487
CB1 binding score: -18.957
InChIKey:YMEKKVVHAIJDRG-UHFFFAOYSA-N
ID: 46735
SMILES:Oc1cc(CC=C(C)CCC=C(C)C)c(O)cc1OC1C=C(C)CC(O)C1C(=C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -17.306
InChIKey:FCBBUXLIMUYMAT-UHFFFAOYSA-N
ID: 46736
SMILES:Oc1c(C(=O)CC(C)C)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.439
InChIKey:MMBSMBBFKYDYEQ-UHFFFAOYSA-N
ID: 46737
SMILES:OC1C(C)(C)Oc2c1cc(O)c1c2C=CC(C)(CCC=C(C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -16.015
InChIKey:XNYLPCXPKJMOLO-UHFFFAOYSA-N
ID: 46738
SMILES:C(CCCCc1cc2c(c(O)c1)C1CC(C)(CCC=C(C)C)OC1(O)C=C(C)C(O)O2)CC(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.693
CB1 binding score: -15.832
InChIKey:PORLQQMJIXSSRK-UHFFFAOYSA-N
ID: 46739
SMILES:Oc1c(C(C(C)CC)=O)c2c(c(O)c1C1C=C(CO)CCC1C(C)=C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -14.555
InChIKey:HDQQFQDQYBBVIV-UHFFFAOYSA-N
ID: 46740
SMILES:C1(CCC=C(C)C)(C)C2C(c3c(cc(CCCCC)cc3O)O1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.828
InChIKey:VWVYPBSOQKGBDL-UHFFFAOYSA-N
ID: 46741
SMILES:C(C)(C)=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 46742
SMILES:c1c(CCCCCC)cc(O)c(CC=C(C)C)c1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.393
CB1 binding score: -18.06
InChIKey:DUNLYOQOJQUZRD-UHFFFAOYSA-N
ID: 46743
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 46744
SMILES:C(C1=CC(=O)C=C(C)C12CCC(C(=C)C=O)C2)(C)CCC=C(C)COC(c1cc(CCCCC)cc(O)c1O)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.72
CB1 binding score: -15.614
InChIKey:POGGFOFSESIGTK-UHFFFAOYSA-N
ID: 46745
SMILES:C(CCC)Cc1cc(O)c(C2CC(C(CO)=C)CC2(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.527
InChIKey:BWMBUUINMSNKJZ-UHFFFAOYSA-N
ID: 46746
SMILES:C1(C)C(Cc2c(O)cc(CCCCC)cc2O)(O)C2C(C3(C)C1CC(C)(C)C3)C(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.628
CB1 binding score: -14.559
InChIKey:XZIGLKZGMYWVRY-UHFFFAOYSA-N