ID: 30640
SMILES:C1C=C(C)C(Cc2c(O)cc(CCC)cc2O)(CO)C2C3(C)C(OC(C)(C)C(O)C3)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.612
CB1 binding score: -12.521
InChIKey:JNPHVBYECFWJKU-UHFFFAOYSA-N
ID: 30641
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)C12O)CC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -15.183
InChIKey:MVDWOROJJYKSKK-UHFFFAOYSA-N
ID: 30642
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: 30643
SMILES:C(c1c(=O)c(O)c2c(cc1O)OC(C)(C)C1CC=C(C)CC21)CCC(CCC=C(C)C)(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.435
InChIKey:SEJFGTSMPYHJCL-UHFFFAOYSA-N
ID: 30644
SMILES:C1C=C(CC(C)C)c2c(c(CCC(=O)C=C(CO)C)c3c4c2OC(C)(C)C(C3)CC4)c(C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -16.209
InChIKey:JPWIXLLUCSPXLX-UHFFFAOYSA-N
ID: 30645
SMILES:C(CCCCC)Cc1cc2c(c(O)c1)C1C=C(C(=O)O)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -19.868
InChIKey:YFHOFGSUSPSPHT-UHFFFAOYSA-N
ID: 30646
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C3C(C)(C4CC(C=O)=CC4(O)CC(C)C(=O)C3C2=O)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.547
CB1 binding score: -14.565
InChIKey:SLZAMOXYFSPULQ-UHFFFAOYSA-N
ID: 30647
SMILES:CC12CCCC(O)(C)C1Cc1c(O)cc(CCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.613
InChIKey:IODUTBMVVZUIRG-UHFFFAOYSA-N
ID: 30648
SMILES:C(=C(C)C)CCC1=CCC(C(=CCCCC)Cc2cc(OC)c(O)c(C=O)c2O)C(C)(C)C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -13.356
InChIKey:YXROJRVPVPNDMY-UHFFFAOYSA-N
ID: 30649
SMILES:Oc1c(CCCCC)cc2c(c1O)C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.584
InChIKey:LSKAJKMGJRXDGK-UHFFFAOYSA-N
ID: 30650
SMILES:c12c(cc(CCCCC)cc1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.229
InChIKey:WPXCENVWOMHAGF-UHFFFAOYSA-N
ID: 30651
SMILES:C(#CC1=C(C)CC2C(C1)C(C)(C)Oc1c2cc(C)c(O)c1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 336.475
CB1 binding score: -15.535
InChIKey:KAVMLHBIGICKMM-UHFFFAOYSA-N
ID: 30652
SMILES:C12(C)CC(CC1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.087
InChIKey:NFCBTGIZLRXKKF-UHFFFAOYSA-N
ID: 30653
SMILES:C(C(O)C)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.881
InChIKey:NARKNZQTZXHZMI-UHFFFAOYSA-N
ID: 30654
SMILES:C1(C)(C)CC(=O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.365
InChIKey:XXGQKUOUWBYZKX-UHFFFAOYSA-N
ID: 30655
SMILES:C(C(O)c1cc2c(c(O)c1CCCCC)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.082
InChIKey:TVQAKYCRNZPDFF-UHFFFAOYSA-N
ID: 30656
SMILES:C1(C(OCC)=O)=Cc2c(cc(CCCCC)cc2O)OC(C)(C)C(OC(C2(C)OC2C)=O)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.55
CB1 binding score: -16.688
InChIKey:PZLREMPHUCQOJO-UHFFFAOYSA-N
ID: 30657
SMILES:C1C(c2c(O)cc(CCCCC)cc2)OC(C)(C)C2CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.285
InChIKey:LDIXZFLHRJGNFW-UHFFFAOYSA-N
ID: 30658
SMILES:C1=C(C)C(=O)CC2C(C)(C)Oc3c(c(O)cc(CCCCCCCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.502
InChIKey:YXGKOPHLRIZYDQ-UHFFFAOYSA-N
ID: 30659
SMILES:C(C)CCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 30660
SMILES:c12c(cccc1O)Oc1c(ccc(CCCC(C)=C3C(CCC(O)=O)(C)C(C(=C)C)CC3)c1)OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.613
CB1 binding score: -15.694
InChIKey:HVZUTHQJLALLRB-UHFFFAOYSA-N