ID: 62791
SMILES:Oc1c2c(ccc1)C(C)(C)Oc1c(c(O)cc(CCCCC)c1)C2=C(C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.674
CB1 binding score: -13.249
InChIKey:PMEDITIOJNEWMW-UHFFFAOYSA-N
ID: 62792
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(CCCCCO)c(O)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.867
InChIKey:VFQTUAYDYIRIAU-UHFFFAOYSA-N
ID: 62793
SMILES:CC1(CCC=C(C)C)C=Cc2c(cc(CCCCC)cc2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.06
InChIKey:KSDSETBZUIJIFF-UHFFFAOYSA-N
ID: 62794
SMILES:CC1(C)Oc2cc(O)cc(CCCCC)c2C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.296
InChIKey:SBDHCUZETSWOAX-UHFFFAOYSA-N
ID: 62795
SMILES:C1C(C)(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.242
InChIKey:JTRCKCGMBPGREQ-UHFFFAOYSA-N
ID: 62796
SMILES:c1(O)c(C2OC(C=C(C)CCC=C(C)CCC=C(C)C)CC2C)c(O)cc(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -17.181
InChIKey:LJWHHYWTNDFRFL-UHFFFAOYSA-N
ID: 62797
SMILES:C(c1c(O)c(CC2(C)C(C)=CCCC2C)cc(OS(O)(=O)=O)c1)C=C(C)C(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.543
CB1 binding score: -15.037
InChIKey:XNMIKDJHCXSPQC-UHFFFAOYSA-N
ID: 62798
SMILES:C1(C(=O)C)C(C(C)=C)CCC2(C)C1c1c(cc(CCCCC)c(C(=O)O)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -14.553
InChIKey:VUSQSBDLPQQRFJ-UHFFFAOYSA-N
ID: 62799
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCCC)cc3O1)CC(C)=CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 62800
SMILES:C1C2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2C)CCC1(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.281
InChIKey:IYSNZMGGGQEIBK-UHFFFAOYSA-N
ID: 62801
SMILES:C(C)(=CCc1c(O)c(CC=C(CCC=C(C)C)C)cc(O)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.748
InChIKey:VRXKPPYOGGSRFK-UHFFFAOYSA-N
ID: 62802
SMILES:CCCCCc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 62803
SMILES:O(c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C)=CC21)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.544
InChIKey:PDNNZTCGRLQWKO-UHFFFAOYSA-N
ID: 62804
SMILES:C1CC(C(C)=C)C(c2c(O)cc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -14.688
InChIKey:SLISAUQDBRTKKY-UHFFFAOYSA-N
ID: 62805
SMILES:C1(C)C(C(=CC=CC(C(CCCC)C)O)C)CCC1(Cc1cc(OC)cc(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.63
CB1 binding score: -15.895
InChIKey:SKGHJTXJVISFQQ-UHFFFAOYSA-N
ID: 62806
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1=C2C(O)C2(C)CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.372
InChIKey:SPDCFIGAIZASBH-UHFFFAOYSA-N
ID: 62807
SMILES:CC1(C)Oc2c(c(O)cc(CC=C)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 62808
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 62809
SMILES:c12cc3c(cc1c(O)c(OC)cc2)OC(C)(C)C1C3C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -16.069
InChIKey:WJYLEWVWZVVHKQ-UHFFFAOYSA-N
ID: 62810
SMILES:C1CC(=C)CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.768
InChIKey:IHYURFWIKUPFCB-UHFFFAOYSA-N
ID: 62811
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2C=C(C(C)C)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -15.12
InChIKey:CBKLPDDFAIVKFU-UHFFFAOYSA-N