ID: 92569
SMILES:C1(CC)=CC(=O)C2(N=CO)C1c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 371.477
CB1 binding score: -14.177
InChIKey:XBBPTAVMZIRPKV-UHFFFAOYSA-N
ID: 92570
SMILES:C1(C)(C=CCC(O)(C)CCC=C(C)C)Oc2c(cc(CCCCC)cc2O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -15.743
InChIKey:ORLPNKSAZULVEY-UHFFFAOYSA-N
ID: 92571
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92572
SMILES:C1CC(=C)CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C3C(O)(C)CCC132
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.041
InChIKey:HEWMSJFFNSMWFI-UHFFFAOYSA-N
ID: 92573
SMILES:CCCCCc1cc(OC)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 92574
SMILES:C(c1c(O)cc(CCCCC)cc1O)(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 290.447
CB1 binding score: -17.404
InChIKey:LIFOCERVKVJSNG-UHFFFAOYSA-N
ID: 92575
SMILES:CCCCCc1cc(O)c(C2C(C(C)C)CC(O)C(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 316.485
CB1 binding score: -18.334
InChIKey:JKMFOEAOXWUEFP-UHFFFAOYSA-N
ID: 92576
SMILES:C(C(C)Cc1occ(C)c1)(Oc1c(C)c2c(c(OC)c1C=O)OC(C)(C)C1C2C=C(C)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -15.527
InChIKey:ODLDGFMXTVUDRI-UHFFFAOYSA-N
ID: 92577
SMILES:c1(O)c(CC=C(C)C)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.281
InChIKey:XRMAOXZXTDWHKU-UHFFFAOYSA-N
ID: 92578
SMILES:C1=CC(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -20.081
InChIKey:XLSYFQOJMWXOCT-UHFFFAOYSA-N
ID: 92579
SMILES:C(CCCc1cc(C2C=C(C)CCC2C(O)(C)C)c(O)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.446
InChIKey:GITOBDJNUCTGFC-UHFFFAOYSA-N
ID: 92580
SMILES:C(C(C)C)CCc1cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -16.169
InChIKey:SJFPHPHWHQHBHY-UHFFFAOYSA-N
ID: 92581
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=C2C2C(O2)C12C(C)(C)O2)C=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.592
CB1 binding score: -11.745
InChIKey:PEHFRNPMTVVQRS-UHFFFAOYSA-N
ID: 92582
SMILES:C(C1=C(O)C(CCC(C)=CCc2c(O)c(CC=C(C)C)c(O)cc2)C(C(C)C)CC1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -16.07
InChIKey:ONLBEJIHGIVSHP-UHFFFAOYSA-N
ID: 92583
SMILES:C(C1CCC2=C(c3c(OC)cc(CCCC)cc3OC2(C)C)C1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -9.557
InChIKey:BUIDQQPLDFAXNQ-UHFFFAOYSA-N
ID: 92584
SMILES:O1c2c(C(OC)=O)c(CCCCC)cc(O)c2C2CC(C)=CCC2(O)C1C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.698
InChIKey:PJBDGOTUWYWNQL-UHFFFAOYSA-N
ID: 92585
SMILES:C1(C)=C2C(C(C)(C)CC2O)CCC2(C)Oc3c(c(OC)cc(CCCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: Not available
InChIKey:PCRSKDLMRWMLFC-UHFFFAOYSA-N
ID: 92586
SMILES:c1c(O)cc2c3c1OC(C)(C)C1C3C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -12.72
InChIKey:GAFVPGVFANEOIZ-UHFFFAOYSA-N
ID: 92587
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 92588
SMILES:c1(CCCCC)cc2c(c(O)c1C(=O)O)OC(C)(C)C1OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -12.435
InChIKey:WFKKDYPNQRWHRV-UHFFFAOYSA-N
ID: 92589
SMILES:Cc1c2c(c3c(c1)OCO3)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.28
InChIKey:CWAGTPNAFKZDAM-UHFFFAOYSA-N