ID: 47398
SMILES:C=C(C)C1CCC(C)=CCCC2(C)Oc3c(c(O)cc(CCCCC)c3O)CC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 440.668
CB1 binding score: -16.303
InChIKey:KSGNNRIRCDODSU-UHFFFAOYSA-N
ID: 47399
SMILES:O=C(C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC2C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.388
InChIKey:HLBAMVQIKJUZKB-UHFFFAOYSA-N
ID: 47400
SMILES:C(C(O)C(O)=O)OCC1=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.539
CB1 binding score: -16.11
InChIKey:GYKZHVAHDCQDAM-UHFFFAOYSA-N
ID: 47401
SMILES:C(C)(=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 47402
SMILES:Oc1cc(CCC)cc2c1C1C(CCC(CO)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.9
InChIKey:UWBCYGUAEGZJRC-UHFFFAOYSA-N
ID: 47403
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 47404
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C=O)=CC1)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.213
InChIKey:QDXGCBWRHSJDQJ-UHFFFAOYSA-N
ID: 47405
SMILES:O(c1cc(CCCCC)cc(O)c1CC=C(CCC=C(C)C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 47406
SMILES:Oc1cc(CC)cc(O)c1CC=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 47407
SMILES:C(CCCC)c1cc2c(c(OC)c1)OC1(C(C)CC(=O)C(C(CCC(OC)=O)C1(O)C)CCC=C(C)C)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.73
CB1 binding score: -11.128
InChIKey:FUCWHDLYPCWASA-UHFFFAOYSA-N
ID: 47408
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(CCCCC)c1)C1C=C(C=CC=C(C)CCC=C(CO)C)C(=O)CC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -14.935
InChIKey:JSSQXNNFAJMFRQ-UHFFFAOYSA-N
ID: 47409
SMILES:C1CC(C)(O)C2OC1C(C)(C)Oc1c2c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -15.624
InChIKey:GTGJQMSEMYKREF-UHFFFAOYSA-N
ID: 47410
SMILES:CCCCCc1cc2c(c(O)c1)C1CC(C)(CCC1C(O)(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.841
InChIKey:UKPNRAMYBFBWKV-UHFFFAOYSA-N
ID: 47411
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.622
InChIKey:NEBZNJDFIPBXCS-UHFFFAOYSA-N
ID: 47412
SMILES:C12=C(c3c(cc(CCCCC)cc3O)OC1(C)C)CC(C)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -18.797
InChIKey:RRDGRYPQJSYRLC-UHFFFAOYSA-N
ID: 47413
SMILES:C1(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C(O)=O)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.496
InChIKey:GLELXQOALSIMRJ-UHFFFAOYSA-N
ID: 47414
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C(O)=O)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 47415
SMILES:c1c(CCCc2cc(O)c(C3C(C(C)=C)CCC(C)=C3)c(O)c2)ccc(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -16.438
InChIKey:ULIJLDSKKNVRSV-UHFFFAOYSA-N
ID: 47416
SMILES:CC1(C)Oc2c(c3c(cc(CCCCC)cc3O)OC2(C)C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.142
InChIKey:ZDKBHOITQRQBFF-UHFFFAOYSA-N
ID: 47417
SMILES:Oc1ccc(CCCc2cc(O)c3c(c2)OC(C)(C)C2C3CC(C)CCC2C(C)C)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.308
InChIKey:YHAXPYDWCSWIIL-UHFFFAOYSA-N
ID: 47418
SMILES:C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -17.08
InChIKey:VZZDHGPGZPRUBW-UHFFFAOYSA-N