ID: 98428
SMILES:Oc1c(C(=O)C(C)C)c2c(c(O)c1)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.896
InChIKey:YAFMVAAAXLTYHW-UHFFFAOYSA-N
ID: 98429
SMILES:c1(O)c(CCNC)cc(OC)c(C2C=C(C)CCC2C(=C)C)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 331.456
CB1 binding score: -15.269
InChIKey:UQDMGOBRTCWIDG-UHFFFAOYSA-N
ID: 98430
SMILES:C(=CC=CC(C)=CC(CC(C)C)(C)O)(C1Oc2c3c(cc(C(O)C(=O)OC)c2)OC3(C)CC1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.606
CB1 binding score: -15.888
InChIKey:YBWCJYRMACPNHB-UHFFFAOYSA-N
ID: 98431
SMILES:c1(O)c2c(cc(C(C(C)CC)O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -12.167
InChIKey:CRCYBCBKHBEOCE-UHFFFAOYSA-N
ID: 98432
SMILES:Oc1ccccc1COc1cc(CCCCC)cc2c1OC1C(C)(CCC3(O)C(C)(C)CC=C(C(O)=O)CC31)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.692
CB1 binding score: -14.161
InChIKey:YQFZALPRYNXQRT-UHFFFAOYSA-N
ID: 98433
SMILES:C1(C)(C)C2CCC(=C)CC2c2cc(C(O)=O)c(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.374
InChIKey:WXGNZRYDXOJVMJ-UHFFFAOYSA-N
ID: 98434
SMILES:C(CCc1c(O)cc(CCCCC)cc1O)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.926
InChIKey:ZEEARGRNCQSHPQ-UHFFFAOYSA-N
ID: 98435
SMILES:C(=Cc1c(O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -15.98
InChIKey:KZJNZPPJXKDQEO-UHFFFAOYSA-N
ID: 98436
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98437
SMILES:O=Cc1c(O)c(C(C=CC)=O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.419
CB1 binding score: -13.39
InChIKey:WVYXHDWKZNYALO-UHFFFAOYSA-N
ID: 98438
SMILES:c1(C)cc(CCCCC)c2c(c1O)C=CC(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -16.575
InChIKey:SFEKYLXEJNAADN-UHFFFAOYSA-N
ID: 98439
SMILES:C(CCCc1cc(O)c(CC2C(C)(O)CCC3C2(C)CCC(=O)C(C)(C)O3)cc1O)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.693
CB1 binding score: -14.035
InChIKey:UKFGUSIALZDVEH-UHFFFAOYSA-N
ID: 98440
SMILES:C(C)(C)C1(O)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.686
InChIKey:JXLOXQRGEOZDJN-UHFFFAOYSA-N
ID: 98441
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)c1c2cccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.41
CB1 binding score: -17.752
InChIKey:CJFQORFGFVBCSD-UHFFFAOYSA-N
ID: 98442
SMILES:C1(=C)CCC(C(C)C)C(c2c(OC(=O)C)cc(CCCCC)cc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.337
InChIKey:UFSPUYQOKVKPRI-UHFFFAOYSA-N
ID: 98443
SMILES:c1c(CCCC(CCC)C)cc(C2C(C(C)=C)CCC(C)=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.552
CB1 binding score: -15.372
InChIKey:ZWLBORLKJWGVQK-UHFFFAOYSA-N
ID: 98444
SMILES:c1c(C)c(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -16.571
InChIKey:TUIFRPSNLLPPJE-UHFFFAOYSA-N
ID: 98445
SMILES:NC(=C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -15.502
InChIKey:RNRAMLWGDDVIRW-UHFFFAOYSA-N
ID: 98446
SMILES:C12C(C)(C)CCCC1(C)Oc1c(c(O)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 98447
SMILES:C(CCCc1cc(O)c(C(=O)CC2C(=C)CCCC2(C)C)c(O)c1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.16
InChIKey:JBZDDMJIQWODNU-UHFFFAOYSA-N
ID: 98448
SMILES:c1(-c2c(O)c(O)c(C(O)C)cc2)c(CCCCC)cc(O)c2c1OC1(C)CCC(O)C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.633
CB1 binding score: -16.015
InChIKey:AIWFKDCNOJPIPL-UHFFFAOYSA-N