ID: 102712
SMILES:C1(C)(O)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 102713
SMILES:CC1(C)Oc2c(c(OC)cc(CCCCC)c2)C2C=C(C)CCC(=O)C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.191
InChIKey:UDEYVEYVDUHTRL-UHFFFAOYSA-N
ID: 102714
SMILES:C(C)(=CCOc1c2c(cc(CCCCC)c1)OC(C)(C)C=CC2=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.636
InChIKey:BULQDJRHBDTGFC-UHFFFAOYSA-N
ID: 102715
SMILES:C1(O)(C)CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 102716
SMILES:O1C(C)(C)C(O)Cc2c(CCCCC)cc(O)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -16.97
InChIKey:AAMBLZHCTYZEJW-UHFFFAOYSA-N
ID: 102717
SMILES:C1C(C(C)(O)C)C(c2cc(CCCCC)cc(O)c2C=O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -18.624
InChIKey:MRSNWPUAWZRFHB-UHFFFAOYSA-N
ID: 102718
SMILES:C1CC(C)=CC(c2c(O)c(CC=C(C)CCC=C(C)C)c(O)cc2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.208
InChIKey:ACQMTYCHFUGORS-UHFFFAOYSA-N
ID: 102719
SMILES:CC1CCC2(C)C(CCC=C2C)C1(C)C1c2c(O)cc(CCC)cc2OC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.161
InChIKey:KTAOFDUGSCTLRJ-UHFFFAOYSA-N
ID: 102720
SMILES:O=C(c1c(CCC)cc(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c1O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 102721
SMILES:C1C2(O)C(O)C=C(CO)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -15.929
InChIKey:MQRFBOFODAKDOX-UHFFFAOYSA-N
ID: 102722
SMILES:C(=Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -17.329
InChIKey:UXMYALNHHLVVAU-UHFFFAOYSA-N
ID: 102723
SMILES:O=C(C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.924
InChIKey:WMPVSTZBXJAQLO-UHFFFAOYSA-N
ID: 102724
SMILES:C1C(C(C)C)C(c2c(O)cc(CCC)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -20.128
InChIKey:YOJPFISTURZHJT-UHFFFAOYSA-N
ID: 102725
SMILES:O1C2(C)C(O)CC3c4c(O)cc(CCCCC)cc4OC(O)(C1)C23C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -18.466
InChIKey:CJUWVKIVSDGLLD-UHFFFAOYSA-N
ID: 102726
SMILES:C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 102727
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)C=CCC=CCC=CCC=CCC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 490.728
CB1 binding score: -16.227
InChIKey:ZSDFKYJJOWRYEE-UHFFFAOYSA-N
ID: 102728
SMILES:C12(C)C(CCC3(C)C1C(O)c1c(O)cc(CCCCC)cc1O3)C(C)(C)CC=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -13.505
InChIKey:CEDZINIOCNQHQO-UHFFFAOYSA-N
ID: 102729
SMILES:O(C)c1c(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.273
InChIKey:QQKRWAQYJVGZFH-UHFFFAOYSA-N
ID: 102730
SMILES:c1(C(C)C)cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.72
InChIKey:MRWXCLDGBJQAHZ-UHFFFAOYSA-N
ID: 102731
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CCC)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.187
InChIKey:ZKXZJUZIDUHJLH-UHFFFAOYSA-N
ID: 102732
SMILES:c1c(O)c(C)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -19.623
InChIKey:MUNXTPXTGBOZLU-UHFFFAOYSA-N