ID: 97756
SMILES:CC1(C)C=Cc2c(cc3c(c2CCCCC)OC(C)(C)C(C)O3)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -14.641
InChIKey:OVHNKHPONLKJHM-UHFFFAOYSA-N
ID: 97757
SMILES:C1(C(C)(CCC=C(CO)CO)O)Cc2c(cc3c(c2C)CC1O)OC(C)(C)C1C3C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -15.38
InChIKey:YMGYBPRKSXFHGO-UHFFFAOYSA-N
ID: 97758
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(COC(=O)C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.773
InChIKey:ILHSUWMZKIAMCQ-UHFFFAOYSA-N
ID: 97759
SMILES:C(CCCCC)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -19.71
InChIKey:SFWRRSGOJSILSQ-UHFFFAOYSA-N
ID: 97760
SMILES:C1(C)=CCCC(C)=CC2C(CC1)C(C)(C)Oc1cc(CCc3ccccc3)cc(O)c12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.605
CB1 binding score: -14.868
InChIKey:WDZRMJGJSYCJSC-UHFFFAOYSA-N
ID: 97761
SMILES:C12c3c(cc(CCCCC)cc3OC)OC(C)(C)C1CCC2(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.782
InChIKey:CFJOFYMFLMHFLW-UHFFFAOYSA-N
ID: 97762
SMILES:C(CC)CCc1cc2c(c(O)c1)C1C=C(C(=O)OC)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 97763
SMILES:C1=C(C)C(O)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 97764
SMILES:C(CC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -17.95
InChIKey:YCGKZROQHXAHBE-UHFFFAOYSA-N
ID: 97765
SMILES:C1C2c3c(ccc(O)c3C3C(C(=C)C)CCC4(C)Oc5c(cc(CCCCC)cc5O)C3C14O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -14.452
InChIKey:VEJBPOJPFJZBKI-UHFFFAOYSA-N
ID: 97766
SMILES:COc1cc(CCCCC)c(O)c2c1OC(CCC=C(COC(C)=O)CCC=C(C)C)(C)C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.665
CB1 binding score: -14.073
InChIKey:QCLBPOYURGVEGW-UHFFFAOYSA-N
ID: 97767
SMILES:C(Cc1cc(O)cc(C2C=C(C)CCC2C(=C)C)c1O)COC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.015
InChIKey:IVERWROFKCIXBH-UHFFFAOYSA-N
ID: 97768
SMILES:CC1CC(Cc2c(O)cc(CCC)cc2O)C(C(CCC=C(C)C)C)C(=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.976
InChIKey:AXXHLVXUYDXPSH-UHFFFAOYSA-N
ID: 97769
SMILES:c1(O)cc2c(cc1CCCCC)OC(C)(C)C(=O)C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 262.349
CB1 binding score: -15.889
InChIKey:HINXCUGEISYNQI-UHFFFAOYSA-N
ID: 97770
SMILES:c1(O)c(=O)c2c(cc(CCCCC)c1)OC(C)(C)C1(O2)CC(O)C(C)=C2C1(C)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.607
CB1 binding score: Not available
InChIKey:KXCXVRJRTHMXMA-UHFFFAOYSA-N
ID: 97771
SMILES:C(C)CCc1cc2c(c(O)c1)C1C=C(C(C)C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.929
InChIKey:NTUSKGIQAMVQFE-UHFFFAOYSA-N
ID: 97772
SMILES:C(C1=CCCC2(C)OC2Cc2c(O)cc(CCCC)cc21)(CCC=C(C)C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -16.759
InChIKey:FPYBAPBCLZUGKP-UHFFFAOYSA-N
ID: 97773
SMILES:C(CCCC(C)=CCc1c(O)cc(CCCCC)c(C(O)=O)c1O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.966
InChIKey:MMTAGSVAZBXWDD-UHFFFAOYSA-N
ID: 97774
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 97775
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C)CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.797
InChIKey:UQOUHXDCXBITSF-UHFFFAOYSA-N
ID: 97776
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3)C(C2C(=C)C)C=C(C)CCC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.653
CB1 binding score: -14.869
InChIKey:DCTPQLLDCHHSJP-UHFFFAOYSA-N